Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5317 | 0.96 | — | — | |
| SCHEMBL9748073 | 0.93 | NPC1 (0.34) | TSHRMEN1KMT2AMAPT | |
| SCHEMBL10965093 | 0.92 | TSHR (0.33) | TSHR | |
| SCHEMBL1366320 | 0.89 | — | — | |
| SCHEMBL17746741 | 0.89 | TSHR (0.33) | TSHRMEN1KMT2ATHRBHTT | |
| SCHEMBL23512039 | 0.85 | CYP3A4 (0.34) | TSHRMEN1KMT2ATHRBHTT | |
| SCHEMBL1841223 | 0.85 | — | — | |
| SCHEMBL17293532 | 0.85 | MEN1 (0.61) | TSHRMEN1KMT2ATHRBHTT | |
| SCHEMBL23466899 | 0.85 | MEN1 (0.61) | TSHRMEN1KMT2ATHRBHTT | |
| Triethylene Glycol SCHEMBL28276568 | 0.85 | MEN1 (0.61) | TSHRMEN1KMT2ATHRBHTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4348377-A | RADIOPACITY | BRACCO INDUSTRIA CHIMICA S.P.A. (IT) | 1982-09-07 | — | — | US | disclosed |
| EP-0023992-B1 | DERIVATIVES OF 2,4,6-TRIODO-ISOPHTHALIC ACID, PROCESS FOR THEIR PREPARATION AND X-RAY CONTRAST AGENTS CONTAINING THEM | BRACCO INDUSTRIA CHIMICA Società per Azioni (IT) | 1982-06-23 | — | — | EP | disclosed |
| EP-0023992-A1 | Derivatives of 2,4,6-triodo-isophthalic acid, process for their preparation and X-ray contrast agents containing them | BRACCO INDUSTRIA CHIMICA Società per Azioni (IT) | 1981-02-18 | — | — | EP | disclosed |